Glycoside
GD130352
Name:
2-(hydroxymethyl)-5-({2-methyl-4-[(9H-purin-6-yl)amino]but-2-en-1-yl}oxy)oxolane-3,4-diolFormula:
C15H21O5N5Smiles:
CC(=CCNc1nc[nH]c2ncnc1-2)COC1OC(CO)C(O)C1OAglycone:
CC(=CCNc1nc[nH]c2ncnc1-2)COSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 7 |
| MolWt: | 351.36 | Num_heavy_atoms: | 25 |
| TPSA: | 145.64 | NumAromaticRings: | 0 |
Unique Aglycone
AD52821
Formula: C10H13ON5
Smiles:
CC(=CCNc1nc[nH]c2ncnc1-2)CO| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 4 |
| MolWt: | 219.25 | Num_heavy_atoms: | 16 |
| TPSA: | 86.72 | NumAromaticRings: | 0 |
